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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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255550 103132902 1 FN2H15C18 AB2C15D18 26.45 2.83 -8.46 -0.65 0
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255551 103132909 1 FON3C11H18 ABC3D11E18 -64.84 2.62 -9.09 0.62 0
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255552 103132918 1 NO2C18H29 AB2C18D29 -95.04 2.9 -8.64 0.35 0
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255553 103132926 1 NO3C17H27 AB3C17D27 -125.48 4.17 -8.51 0.21 0
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255554 103132942 1 ON3C13H19 AB3C13D19 -6.96 5.85 -8.83 -0.21 0
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255555 103132949 1 NO2C15H23 AB2C15D23 -90.89 2.31 -8.57 0.24 0
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255556 103132956 1 NO2C17H21 AB2C17D21 -59.3 2.9 -8.5 -0.54 0
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255557 103132957 1 ON3C12H13 AB3C12D13 27.39 5.27 -8.39 -0.29 0
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255558 103132961 1 ON2C16H20 AB2C16D20 -5.61 4.96 -9.42 -1.15 0
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255559 103132965 1 SN3O3C9H15 AB3C3D9E15 -84.55 6.01 -9.54 -0.4 0
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255560 103132978 1 ON3C13H15 AB3C13D15 27.1 5.6 -9.3 -0.11 0
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255561 103132992 1 ON3C9H15 AB3C9D15 -7.85 5.93 -9.28 -0.25 0
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255562 103133001 1 NO3C17H27 AB3C17D27 -130.47 3.87 -8.5 0.24 0
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255563 103133013 1 ON3C10H17 AB3C10D17 -8.3 4.65 -8.82 -0.09 0
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255564 103133014 1 BrNO2C16H24 ABC2D16E24 -82.38 1.94 -8.99 -0.27 0
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255565 103133025 1 ON2C16H20 AB2C16D20 -8.61 4.41 -8.92 -1.14 0
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255566 103133031 1 ClNO2C14H20 ABC2D14E20 -82.51 2.63 -8.95 -0.13 0
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255567 103133040 1 ON3C10H15 AB3C10D15 21.47 6.96 -8.96 -0.17 0
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255568 103133045 1 ON4C14H22 AB4C14D22 6.03 4.69 -8.43 0.01 0
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255569 103133048 1 ClNO2C16H24 ABC2D16E24 -96.14 5.09 -8.78 -0.06 0
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255570 103133060 1 ON2C13H14 AB2C13D14 13.56 4.29 -9.22 -1.13 0
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255571 103133064 1 N2O2C15H16 A2B2C15D16 -21.48 6.17 -9.57 -1.36 0
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255572 103133089 1 BrNO2C17H26 ABC2D17E26 -87.38 2.6 -9.05 -0.2 0
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255573 103133103 1 NO2C17H27 AB2C17D27 -91.14 3.61 -8.73 0.36 0
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255574 103133108 1 ON3C9H15 AB3C9D15 -1.9 4.57 -8.89 -0.1 0